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19955-99-8 | Benzaldehyde, 3-ethenyl-
CAS No: 19955-99-8 Catalog No: AG002C6I MDL No:MFCD02093761
Product Description
Catalog Number:
AG002C6I
Chemical Name:
Benzaldehyde, 3-ethenyl-
CAS Number:
19955-99-8
Molecular Formula:
C9H8O
Molecular Weight:
132.1592
MDL Number:
MFCD02093761
IUPAC Name:
3-ethenylbenzaldehyde
InChI:
InChI=1S/C9H8O/c1-2-8-4-3-5-9(6-8)7-10/h2-7H,1H2
InChI Key:
CATOVPRCMWIZLR-UHFFFAOYSA-N
SMILES:
C=Cc1cccc(c1)C=O
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.058g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.162g/mol
Monoisotopic Mass:
132.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| A versatile approach to high-throughput microarrays using thiol-ene chemistry. | Nature chemistry 20100201 |
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